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	hartrees
Energy at 0K	-454.598739
Energy at 298.15K	-454.608543
HF Energy	-454.399851
Nuclear repulsion energy	176.283131

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3531	3079	9.91
2	A₁	3353	2924	1.68
3	A₁	1747	1523	2.11
4	A₁	1601	1395	0.40
5	A₁	1130	985	25.41
6	A₁	787	686	0.14
7	A₁	349	304	1.93
8	A₂	3541	3087	0.00
9	A₂	1743	1520	0.00
10	A₂	967	843	0.00
11	A₂	179	156	0.00
12	E	3542	3088	2.87
12	E	3542	3088	2.87
13	E	3532	3079	0.98
13	E	3532	3079	0.98
14	E	3356	2926	2.39
14	E	3356	2926	2.39
15	E	1746	1522	1.50
15	E	1746	1522	1.50
16	E	1742	1519	2.22
16	E	1742	1519	2.22
17	E	1578	1376	4.29
17	E	1578	1376	4.29
18	E	1106	964	19.45
18	E	1106	964	19.45
19	E	1006	877	0.51
19	E	1006	877	0.51
20	E	849	740	6.60
20	E	849	740	6.60
21	E	294	256	0.56
21	E	294	256	0.56
22	E	195	170	0.02
22	E	195	170	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.637
C2	0.000	1.616	-0.292
C3	1.399	-0.808	-0.292
C4	-1.399	-0.808	-0.292
H5	0.000	1.482	-1.387
H6	-0.889	2.210	-0.025
H7	0.889	2.210	-0.025
H8	1.283	-0.741	-1.387
H9	2.359	-0.336	-0.025
H10	1.470	-1.875	-0.025
H11	-1.283	-0.741	-1.387
H12	-1.470	-1.875	-0.025
H13	-2.359	-0.336	-0.025

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8635	1.8635	1.8635	2.5080	2.4725	2.4725	2.5080	2.4725	2.4725	2.5080	2.4725	2.4725
C2	1.8635		2.7985	2.7985	1.1032	1.1021	1.1021	2.8981	3.0727	3.7968	2.8981	3.7968	3.0727
C3	1.8635	2.7985		2.7985	2.8981	3.7968	3.0727	1.1032	1.1021	1.1021	2.8981	3.0727	3.7968
C4	1.8635	2.7985	2.7985		2.8981	3.0727	3.7968	2.8981	3.7968	3.0727	1.1032	1.1021	1.1021
H5	2.5080	1.1032	2.8981	2.8981		1.7819	1.7819	2.5664	3.2741	3.9091	2.5664	3.9091	3.2741
H6	2.4725	1.1021	3.7968	3.0727	1.7819		1.7774	3.9091	4.1263	4.7171	3.2741	4.1263	2.9397
H7	2.4725	1.1021	3.0727	3.7968	1.7819	1.7774		3.2741	2.9397	4.1263	3.9091	4.7171	4.1263
H8	2.5080	2.8981	1.1032	2.8981	2.5664	3.9091	3.2741		1.7819	1.7819	2.5664	3.2741	3.9091
H9	2.4725	3.0727	1.1021	3.7968	3.2741	4.1263	2.9397	1.7819		1.7774	3.9091	4.1263	4.7171
H10	2.4725	3.7968	1.1021	3.0727	3.9091	4.7171	4.1263	1.7819	1.7774		3.2741	2.9397	4.1263
H11	2.5080	2.8981	2.8981	1.1032	2.5664	3.2741	3.9091	2.5664	3.9091	3.2741		1.7819	1.7819
H12	2.4725	3.7968	3.0727	1.1021	3.9091	4.1263	4.7171	3.2741	4.1263	2.9397	1.7819		1.7774
H13	2.4725	3.0727	3.7968	1.1021	3.2741	2.9397	4.1263	3.9091	4.7171	4.1263	1.7819	1.7774

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	112.908	P1	C2	H6	110.316
P1	C2	H7	110.316	P1	C3	H8	112.908
P1	C3	H9	110.316	P1	C3	H10	110.316
P1	C4	H11	112.908	P1	C4	H12	110.316
P1	C4	H13	110.316	C2	P1	C3	97.331
C2	P1	C4	97.331	C3	P1	C4	97.331
H5	C2	H6	107.806	H5	C2	H7	107.806
H6	C2	H7	107.494	H8	C3	H9	107.806
H8	C3	H10	107.806	H9	C3	H10	107.494
H11	C4	H12	107.806	H11	C4	H13	107.806
H12	C4	H13	107.494

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)

using model chemistry: MP2/STO-3G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for P(CH3)3 (trimethylphosphine)

using model chemistry: MP2/STO-3G

States and conformations

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)